BAS 00411368
TL;DR: BAS 00411368 (CAS 1164548-54-2) is a chemical compound with molecular formula C15H19N3O3 and molecular weight 289.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-(dimethylaminomethylideneamino)-5-methoxy-1H-indole-2-carboxylate
Also Known As: BAS 00411368, ethyl 3-[(E)-[(dimethylamino)methylidene]amino]-5-methoxy-1H-indole-2-carboxylate, ethyl 3-{[(1E)-(dimethylamino)methylene]amino}-5-methoxy-1H-indole-2-carboxylate, (E)-Ethyl 3-(((dimethylamino)methylene)amino)-5-methoxy-1H-indole-2-carboxylate, Ethyl 3-([(1e)-(dimethylamino)methylene]amino)-5-methoxy-1h-indole-2-carboxylate
| Molecular Formula | C15H19N3O3 |
|---|---|
| Molecular Weight | 289.14 g/mol |
| LogP | 2.5746 |
| Topological Polar Surface Area | 66.92 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 289.14264 |
| Heavy Atoms | 21 |
| Complexity | 674.0988 |
Chemical Identifiers
| CAS Number | 1164548-54-2 |
|---|---|
| SMILES | CCOC(=O)C1=C(C2=C(N1)C=CC(=C2)OC)N=CN(C)C |
Product Overview
BAS 00411368 (CAS 1164548-54-2), with molecular formula C15H19N3O3 and molecular weight 289.14 g/mol. IUPAC: ethyl 3-(dimethylaminomethylideneamino)-5-methoxy-1H-indole-2-carboxylate.
Chemical Property Profile of BAS 00411368
Property Insights of BAS 00411368
The XLogP value of 2.5746 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 00411368. The TPSA of 66.92 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00411368. Following Lipinski's Rule of Five, BAS 00411368 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00411368?
The CAS number of BAS 00411368 is 1164548-54-2.
What is the molecular formula of BAS 00411368?
The molecular formula of BAS 00411368 is C15H19N3O3.
What is the molecular weight of BAS 00411368?
The molecular weight of BAS 00411368 is 289.14 g/mol.
Where can I buy BAS 00411368?
You can request a quote for BAS 00411368 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00411368?
Yes, KEHONG BIO provides custom synthesis services for BAS 00411368 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.